Name: Name:Pentanoic acid,5-bromo-2,2-dimethyl-4-oxo-, ethyl ester
Brand: Angene
SKU: AG007XLX
Rating: 90 (10 reviews)

Pentanoic acid,5-bromo-2,2-dimethyl-4-oxo-, ethyl ester

CAS No.:

154325-75-4

Catalog Number:

AG007XLX

Molecular Formula:

C9H15BrO3

Molecular Weight:

251.1176

Catalog Number:

AG007XLX

Chemical Name:

Pentanoic acid,5-bromo-2,2-dimethyl-4-oxo-, ethyl ester

CAS Number:

154325-75-4

Molecular Formula:

C9H15BrO3

Molecular Weight:

251.1176

MDL Number:

MFCD04116142

IUPAC Name:

ethyl 5-bromo-2,2-dimethyl-4-oxopentanoate

InChI:

InChI=1S/C9H15BrO3/c1-4-13-8(12)9(2,3)5-7(11)6-10/h4-6H2,1-3H3

InChI Key:

LVXCDNNMZJAPOG-UHFFFAOYSA-N

SMILES:

CCOC(=O)C(CC(=O)CBr)(C)C

Complexity:

199

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

250.02g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

251.12g/mol

Monoisotopic Mass:

250.02g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

43.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8